2-(2-thiophen-2-ylethanoylcarbamothioylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide

Systemtic Name: 2-(2-thiophen-2-ylethanoylcarbamothioylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Openeye Name: 2-[[2-(2-thienyl)acetyl]carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide CAS Name: 2-[[[(1-oxo-2-thiophen-2-ylethyl)amino]-sulfanylidenemethyl]amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide IUPAC Name: 2-[(2-thiophen-2-ylacetyl)carbamothioylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Traditional Name: 2-[[2-(2-thienyl)acetyl]thiocarbamoylamino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide Formula: C18H21N3O2S3 MolecularWeight: 407.57324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C(=C(S2)NC(=S)NC(=O)CC3=CC=CS3)C(=O)N

Isomeric SMILES

C1CCCC2=C(CC1)C(=C(S2)NC(=S)NC(=O)CC3=CC=CS3)C(=O)N

InChI

InChI=1S/C18H21N3O2S3/c19-16(23)15-12-7-3-1-2-4-8-13(12)26-17(15)21-18(24)20-14(22)10-11-6-5-9-25-11/h5-6,9H,1-4,7-8,10H2,(H2,19,23)(H2,20,21,22,24)